[1-(1,3-thiazol-5-yl)cyclopropyl]methanamine

C7H10N2S — CID 82416500

IUPAC[1-(1,3-thiazol-5-yl)cyclopropyl]methanamine
SMILESNCC1(c2cncs2)CC1
InChIInChI=1S/C7H10N2S/c8-4-7(1-2-7)6-3-9-5-10-6/h3,5H,1-2,4,8H2
InChIKeyBKDCQUOQEOTWSD-UHFFFAOYSA-N
MW154.24 g/mol
LogP1.13
Rot. Bonds2

About [1-(1,3-thiazol-5-yl)cyclopropyl]methanamine

[1-(1,3-thiazol-5-yl)cyclopropyl]methanamine (PubChem CID 82416500) has the molecular formula C7H10N2S and a molecular weight of 154.24 g/mol. Its IUPAC name is [1-(1,3-thiazol-5-yl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(1,3-thiazol-5-yl)cyclopropyl]methanamine
PubChem CID82416500
Molecular FormulaC7H10N2S
Molecular Weight154.24 g/mol
Exact Mass154.06
IUPAC Name[1-(1,3-thiazol-5-yl)cyclopropyl]methanamine
SMILESNCC1(c2cncs2)CC1
InChIInChI=1S/C7H10N2S/c8-4-7(1-2-7)6-3-9-5-10-6/h3,5H,1-2,4,8H2
InChIKeyBKDCQUOQEOTWSD-UHFFFAOYSA-N
XLogP1.13
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.24
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(1,3-thiazol-5-yl)cyclopropyl]methanamine?
The IUPAC name of [1-(1,3-thiazol-5-yl)cyclopropyl]methanamine (CID 82416500) is [1-(1,3-thiazol-5-yl)cyclopropyl]methanamine.
What is the SMILES notation for [1-(1,3-thiazol-5-yl)cyclopropyl]methanamine?
The canonical SMILES for [1-(1,3-thiazol-5-yl)cyclopropyl]methanamine is NCC1(c2cncs2)CC1.
What is the InChIKey of [1-(1,3-thiazol-5-yl)cyclopropyl]methanamine?
The InChIKey is BKDCQUOQEOTWSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2S/c8-4-7(1-2-7)6-3-9-5-10-6/h3,5H,1-2,4,8H2.
What are the key properties of [1-(1,3-thiazol-5-yl)cyclopropyl]methanamine?
[1-(1,3-thiazol-5-yl)cyclopropyl]methanamine has a molecular weight of 154.24 g/mol, XLogP of 1.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,3-thiazol-5-yl)cyclopropyl]methanamine is sourced from PubChem (CID 82416500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).